1-cyclopropyl-7-(4-ethyl-3-methyl-piperazin-1-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-(4-ethyl-3-methyl-piperazin-1-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-(4-ethyl-3-methyl-piperazin-1-yl)-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-(4-ethyl-3-methyl-1-piperazinyl)-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-(4-ethyl-3-methylpiperazin-1-yl)-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-(4-ethyl-3-methyl-piperazino)-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C20H23F2N3O3 MolecularWeight: 391.411726

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1C)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

CCN1CCN(CC1C)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C20H23F2N3O3/c1-3-23-6-7-24(9-11(23)2)18-15(21)8-13-17(16(18)22)25(12-4-5-12)10-14(19(13)26)20(27)28/h8,10-12H,3-7,9H2,1-2H3,(H,27,28)